SCHEMBL24577958

SCHEMBL24577958

Cc1cc(=O)n(Cc2ccc(C(=O)NO)c(-c3ccccc3)c2)c(C)n1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HDAC7 Q8WUI4 11/20 0.59
▸ HDAC1 Q13547 10/20 0.59
▸ HDAC6 Q9UBN7 8/20 0.59
▸ HDAC8 Q9BY41 5/20 0.59
▸ HDAC9 Q9UKV0 5/20 0.59
▸ HDAC4 P56524 4/20 0.59
▸ HDAC5 Q9UQL6 4/20 0.59
▸ HDAC2 Q92769 2/20 0.41
▸ HDAC3 O15379 1/20 0.41
▸ HDAC10 Q969S8 1/20 0.41
▸ HDAC11 Q96DB2 1/20 0.41
▸ ROCK2 O75116 1/20 0.40
▸ PIM1 P11309 1/20 0.40
▸ FAAH O00519 1/20 0.39
▸ CNR1 P21554 1/20 0.39
▸ CNR2 P34972 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL24579735 0.83 HDAC7 (0.57) HDAC7HDAC1HDAC6HDAC8HDAC9
SCHEMBL24579574 0.83 HDAC1 (0.65) HDAC7HDAC1HDAC6HDAC8HDAC9
SCHEMBL24578163 0.81 HDAC7 (0.56) HDAC7HDAC1HDAC6HDAC8HDAC9
SCHEMBL24578148 0.80 HDAC7 (0.53) HDAC7HDAC1HDAC6HDAC8HDAC9
SCHEMBL24578110 0.80 HDAC7 (0.54) HDAC7HDAC1HDAC6HDAC8HDAC9
SCHEMBL24578115 0.80 HDAC7 (0.53) HDAC7HDAC1HDAC6HDAC8HDAC9
SCHEMBL24579636 0.76 HDAC7 (0.58) HDAC7HDAC1HDAC6HDAC8HDAC9
SCHEMBL24577966 0.76 HDAC7 (0.61) HDAC7HDAC1HDAC6HDAC8HDAC9
SCHEMBL24579577 0.75 HDAC7 (0.67) HDAC7HDAC1HDAC6HDAC8HDAC9
SCHEMBL24577976 0.75 HDAC7 (1.00) HDAC7HDAC1HDAC6HDAC8HDAC9

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022133551-A1 HISTONE DEACETYLASE INHIBITORS THE UNIVERSITY OF QUEENSLAND (AU) 2022-06-30 — — WO disclosed
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